Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C)N(C(=O)N(CCOCCOCCOCCN2C(C3=CC=C(C=C3)C#N)C(C(=O)OCC)=C(C)N(C2=O)C2=CC=CC(=C2)C(F)(F)F)C1C1=CC=C(C=C1)C#N)C1=CC=CC(=C1)C(F)(F)F

InChIKey

InChIKey=YVAYYFZWQAKGBT-UHFFFAOYSA-N

Formula

C52H50F6N6O9

Mass

1016.995

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Trifluoromethylbenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Trifluoromethylbenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Trifluoromethylbenzene - Hydropyrimidine carboxylic acid derivative - Benzonitrile - Pyrimidone - Dicarboxylic acid or derivatives - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Pyrimidine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Urea - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Nitrile - Carbonitrile - Alkyl halide - Hydrocarbon derivative - Organic oxide - Cyanide - Organohalogen compound - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Alkyl fluoride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.

External Descriptors

Not available

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